BDBM50029272 Cyclohexanecarboxylic acid {5-[4-(2-isopropoxy-phenyl)-piperazin-1-ylmethyl]-1-methyl-1H-pyrrol-2-ylmethyl}-isopropyl-amide;succinate

SMILES: CC(C)Oc1ccccc1N1CCN(Cc2ccc(CN(C(C)C)C(=O)C3CCCCC3)n2C)CC1

InChI Key: InChIKey=ZBHZVMMPAAMZQJ-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50029272   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50029272 (Cyclohexanecarboxylic acid {5-[4-(2-isopropoxy-phe...) Show SMILES CC(C)Oc1ccccc1N1CCN(Cc2ccc(CN(C(C)C)C(=O)C3CCCCC3)n2C)CC1 Show InChI InChI=1S/C30H46N4O2/c1-23(2)34(30(35)25-11-7-6-8-12-25)22-27-16-15-26(31(27)5)21-32-17-19-33(20-18-32)28-13-9-10-14-29(28)36-24(3)4/h9-10,13-16,23-25H,6-8,11-12,17-22H2,1-5H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	4.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity was determined against 5-hydroxytryptamine 1A receptor using [3H]WB-4101				J Med Chem 38: 4198-210 (1995) BindingDB Entry DOI: 10.7270/Q2GX4C61
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50029272 (Cyclohexanecarboxylic acid {5-[4-(2-isopropoxy-phe...) Show SMILES CC(C)Oc1ccccc1N1CCN(Cc2ccc(CN(C(C)C)C(=O)C3CCCCC3)n2C)CC1 Show InChI InChI=1S/C30H46N4O2/c1-23(2)34(30(35)25-11-7-6-8-12-25)22-27-16-15-26(31(27)5)21-32-17-19-33(20-18-32)28-13-9-10-14-29(28)36-24(3)4/h9-10,13-16,23-25H,6-8,11-12,17-22H2,1-5H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
R. W. Johnson Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity was determined against Dopamine receptor D2 using [3H]spiperone				J Med Chem 38: 4198-210 (1995) BindingDB Entry DOI: 10.7270/Q2GX4C61
					More data for this Ligand-Target Pair